5-[(3-carboxy-4-methoxycarbonyl-phenyl)methyl]-2-methoxycarbonyl-benzoic acid

Systemtic Name: 5-[(3-carboxy-4-methoxycarbonyl-phenyl)methyl]-2-methoxycarbonyl-benzoic acid Openeye Name: 5-[(3-carboxy-4-methoxycarbonyl-phenyl)methyl]-2-methoxycarbonyl-benzoic acid CAS Name: 5-[(3-carboxy-4-methoxycarbonylphenyl)methyl]-2-methoxycarbonylbenzoic acid IUPAC Name: 5-[(3-carboxy-4-methoxycarbonylphenyl)methyl]-2-methoxycarbonylbenzoic acid Traditional Name: 2-carbomethoxy-5-(4-carbomethoxy-3-carboxy-benzyl)benzoic acid Formula: C19H16O8 MolecularWeight: 372.32554

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=C(C=C(C=C1)CC2=CC(=C(C=C2)C(=O)OC)C(=O)O)C(=O)O

Isomeric SMILES

COC(=O)C1=C(C=C(C=C1)CC2=CC(=C(C=C2)C(=O)OC)C(=O)O)C(=O)O

InChI

InChI=1S/C19H16O8/c1-26-18(24)12-5-3-10(8-14(12)16(20)21)7-11-4-6-13(19(25)27-2)15(9-11)17(22)23/h3-6,8-9H,7H2,1-2H3,(H,20,21)(H,22,23)